Geometry & MOs

Info

ID:	445146
PubChem CID:	135264678
Reduced:	N2O4C23H24 (1)
Stoich.:	A2B4C23D24 (1)
Weight, g/mol:	446.091246
ΔH_f, kcal/mol:	-133.0
Dipole, Da:	6.51
IP(EA), eV:	-8.99(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dichlorophenyl)-3-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dihydroisoindol-5-yl]methyl]urea

Drug info:

PubChemData

Smile

C1CC2=C(C1)C=C(C=C2)COC3=CC=CC4=C3CN(C4O)C5CCC(=O)NC5=O

DOS

IR

Vibrations